Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | BCHE | P06276 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | CD44 | P16070 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30497776 | 0.98 | PNMT (0.58) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| SCHEMBL221400 | 0.98 | PNMT (0.58) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| Hydrochloric Acid SCHEMBL2866030 | 0.96 | PNMT (0.56) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| Bromide SCHEMBL28349432 | 0.96 | PNMT (0.56) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| Biphenyl SCHEMBL28377104 | 0.94 | PNMT (0.51) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| Phenol SCHEMBL28634798 | 0.91 | PNMT (0.53) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| Dimethylamine SCHEMBL28473739 | 0.90 | PNMT (0.51) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| SCHEMBL3630935 | 0.88 | PNMT (0.56) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| SCHEMBL8436976 | 0.87 | PNMT (0.49) | PNMTALDH1A1NPC1RAB9AKDM4E | |
| SCHEMBL21142139 | 0.86 | PNMT (0.55) | PNMTALDH1A1NPC1RAB9AKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104854082-A | 3,5, N-trihydroxy alkanamide and its derivative, and its preparation method and application | ACADEMIA SINICA | 2015-08-19 | — | — | CN | disclosed |